N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine

C14H28N4 — CID 63109005

IUPACN-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
SMILESCCN(CC)CCc1ncc(CNC(C)(C)C)[nH]1
InChIInChI=1S/C14H28N4/c1-6-18(7-2)9-8-13-15-10-12(17-13)11-16-14(3,4)5/h10,16H,6-9,11H2,1-5H3,(H,15,17)
InChIKeyGZWOGBZJALLLTQ-UHFFFAOYSA-N
MW252.41 g/mol
LogP2.18
Rot. Bonds7

About N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine

N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine (PubChem CID 63109005) has the molecular formula C14H28N4 and a molecular weight of 252.41 g/mol. Its IUPAC name is N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
PubChem CID63109005
Molecular FormulaC14H28N4
Molecular Weight252.41 g/mol
Exact Mass252.23
IUPAC NameN-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
SMILESCCN(CC)CCc1ncc(CNC(C)(C)C)[nH]1
InChIInChI=1S/C14H28N4/c1-6-18(7-2)9-8-13-15-10-12(17-13)11-16-14(3,4)5/h10,16H,6-9,11H2,1-5H3,(H,15,17)
InChIKeyGZWOGBZJALLLTQ-UHFFFAOYSA-N
XLogP2.18
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.41
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[[2-(3-methylbutyl)-1H-imidazol-5-yl]methyl]propan-2-amine
CID 63109067
2-methyl-N-[[2-(methylsulfanylmethyl)-1H-imidazol-5-yl]methyl]propan-2-amine
CID 63109029
N-[[2-[2-(2,2-difluoroethoxy)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
CID 103150869
2-methyl-N-[(2-methyl-1H-imidazol-5-yl)methyl]propan-2-amine
CID 62743796
N-[[2-[(4-chlorophenyl)methyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
CID 55176708
2-methyl-N-[[2-(pyridin-3-ylmethyl)-1H-imidazol-5-yl]methyl]propan-2-amine
CID 63109062
N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine
CID 63108982
N-[[3-[2-(diethylamino)ethyl]-1,2,4-oxadiazol-5-yl]methyl]-2-methylpropan-2-amine
CID 55243449
N-[(2-propyl-1H-imidazol-5-yl)methyl]propan-1-amine
CID 63108587
N-[[2-(5-bromo-2-pyridinyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
CID 113398748
2-methyl-N-[(2-methyl-1H-imidazol-5-yl)methyl]butan-2-amine
CID 62741392
N-[[2-(3,5-dichlorophenyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
CID 107918177

Frequently Asked Questions

What is the IUPAC name of N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine (CID 63109005) is N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine is CCN(CC)CCc1ncc(CNC(C)(C)C)[nH]1.
What is the InChIKey of N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is GZWOGBZJALLLTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4/c1-6-18(7-2)9-8-13-15-10-12(17-13)11-16-14(3,4)5/h10,16H,6-9,11H2,1-5H3,(H,15,17).
What are the key properties of N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine?
N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 252.41 g/mol, XLogP of 2.18, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[2-(diethylamino)ethyl]-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 63109005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).